ethyl 5-(5-bromanyl-2-nitro-phenyl)sulfanyl-4-methoxy-2-methyl-thiophene-3-carboxylate

Systemtic Name: ethyl 5-(5-bromanyl-2-nitro-phenyl)sulfanyl-4-methoxy-2-methyl-thiophene-3-carboxylate Openeye Name: ethyl 5-(5-bromo-2-nitro-phenyl)sulfanyl-4-methoxy-2-methyl-thiophene-3-carboxylate CAS Name: 5-[(5-bromo-2-nitrophenyl)thio]-4-methoxy-2-methyl-3-thiophenecarboxylic acid ethyl ester IUPAC Name: ethyl 5-(5-bromo-2-nitrophenyl)sulfanyl-4-methoxy-2-methylthiophene-3-carboxylate Traditional Name: 5-[(5-bromo-2-nitro-phenyl)thio]-4-methoxy-2-methyl-thiophene-3-carboxylic acid ethyl ester Formula: C15H14BrNO5S2 MolecularWeight: 432.30936

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Descriptors Computed from Structure

Canonical SMILES:

CCOC(=O)C1=C(SC(=C1OC)SC2=C(C=CC(=C2)Br)[N+](=O)[O-])C

Isomeric SMILES

CCOC(=O)C1=C(SC(=C1OC)SC2=C(C=CC(=C2)Br)[N+](=O)[O-])C

InChI

InChI=1S/C15H14BrNO5S2/c1-4-22-14(18)12-8(2)23-15(13(12)21-3)24-11-7-9(16)5-6-10(11)17(19)20/h5-7H,4H2,1-3H3